1-((2R,3R,4S,5R)-4-(benzyloxy)-5-((benzyloxy)methyl)-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione
Basic information
- Standard SMILES
Cc1cn([C@@H]2O[C@](CO)(COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H]2O)c(=O)[nH]c1=O- InChIKey
UMKZDOQLPWHEEH-SWXWDQRWSA-N- Molecular formula
- C25H28N2O7
- Average molar mass
- 468.5 g/mol
- Monoisotopic mass
- 468.18965124
Names & identifiers
- Preferred name
- 1-((2R,3R,4S,5R)-4-(benzyloxy)-5-((benzyloxy)methyl)-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione
- IUPAC
- 1-[(2R,3R,4S,5R)-3-hydroxy-5-(hydroxymethyl)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Names & synonyms
206055-57-41-((2R,3R,4S,5R)-4-(benzyloxy)-5-((benzyloxy)methyl)-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dioneMFCD318038821-(3,5-Di-O-benzyl-4-C-(hydroxymethyl)-beta-D-ribofuranosyl)thymine1-[(2R,3R,4S,5R)-4-(Benzyloxy)-5-[(benzyloxy)methyl]-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methylpyrimidine-2,4(1H,3H)-dioneSCHEMBL1096297UMKZDOQLPWHEEH-SWXWDQRWSA-N1-[(2R,3R,4S,5R)-4-(benzyloxy)-5-[(benzyloxy)methyl]-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dioneSY333347E719401-[(2R,3R,4S,5R)-3-hydroxy-5-(hydroxymethyl)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Database identifiers
- PubChem CID
- 11037985
- Nikkaji
- J1.018.001E
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 748
Related reactions
13 records
Compound notes
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